SCHEMBL6959476

SCHEMBL6959476

CCOC(=O)c1ccccc1CC([O])=O

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.67
ALDH1A1 P00352 4/20 0.57
HSD17B10 Q99714 3/20 0.57
L3MBTL1 Q9Y468 2/20 0.49
CDC25B P30305 2/20 0.49
KDM4E B2RXH2 2/20 0.47
TDP1 Q9NUW8 2/20 0.46
KMT2A Q03164 2/20 0.46
LMNA P02545 2/20 0.46
CYP3A4 P08684 2/20 0.46
CDC25A P30304 1/20 0.46
CDC25C P30307 1/20 0.46
MEN1 O00255 1/20 0.46
USP2 O75604 1/20 0.46
CYP1A2 P05177 1/20 0.46
MAPT P10636 1/20 0.46
CYP2C9 P11712 1/20 0.46
ALOX15 P16050 1/20 0.46
CYP2C19 P33261 1/20 0.46
MAPK10 P53779 1/20 0.46

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL13032652 0.86 TSHR (0.67) TSHRALDH1A1HSD17B10L3MBTL1CDC25B
SCHEMBL1898535 0.86 TSHR (0.67) TSHRALDH1A1HSD17B10L3MBTL1CDC25B
SCHEMBL1492385 0.86 TSHR (0.67) TSHRALDH1A1HSD17B10L3MBTL1CDC25B
SCHEMBL578128 0.85 TSHR (0.77) TSHRALDH1A1HSD17B10L3MBTL1CDC25B
SCHEMBL1492404 0.85 TSHR (0.65) TSHRALDH1A1HSD17B10L3MBTL1CDC25B
SCHEMBL6441720 0.83 TSHR (0.67) TSHRALDH1A1HSD17B10CDC25BKDM4E
SCHEMBL6959625 0.82 ALDH1A1 (0.65) TSHRALDH1A1HSD17B10KDM4EKMT2A
SCHEMBL7670783 0.82 TSHR (0.71) TSHRALDH1A1HSD17B10L3MBTL1CDC25B
SCHEMBL7669334 0.82 TSHR (0.71) TSHRALDH1A1HSD17B10L3MBTL1CDC25B
Bicarbonate SCHEMBL27963013 0.81 TSHR (0.65) TSHRALDH1A1HSD17B10L3MBTL1CDC25B

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1329160-A2 4-ACYLAMINOPYRAZOLE DERIVATIVES Sankyo Company, Limited (JP) 2003-07-23 EP disclosed